NAMES AND DATABASE IDS
NAMES AND DATABASE IDS
Names Database IDs
IUPAC name
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4-[(3-fluorophenyl)methyl]-3-{2-oxo-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethyl}piperazin-2-one
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IUPAC Traditional name
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4-[(3-fluorophenyl)methyl]-3-{2-oxo-2-[4-(pyridin-3-ylmethyl)piperazin-1-yl]ethyl}piperazin-2-one
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Synonyms
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4-(3-fluorobenzyl)-3-{2-oxo-2-[4-(3-pyridinylmethyl)-1-piperazinyl]ethyl}-2-piperazinone
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DATA SOURCES
DATA SOURCES
All Sources Commercial Sources Non-commercial Sources
CALCULATED PROPERTIES
CALCULATED PROPERTIES
JChem
供应商提供(Chembridge)
Acid pKa
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13.507052
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H Acceptors
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5
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H Donor
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1
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LogD (pH = 5.5)
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-0.7864005
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LogD (pH = 7.4)
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0.64516336
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Log P
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0.70181847
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Molar Refractivity
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116.3023 cm3
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Polarizability
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44.798347 Å3
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Polar Surface Area
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68.78 Å2
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Rotatable Bonds
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6
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Lipinski's Rule of Five
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true
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H Acceptors
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5
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H Donor
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1
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Log P
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2.3
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LOG S
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-0.45
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Polar Surface Area
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68.78 Å2
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Rotatable Bonds
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6
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PROPERTIES
PROPERTIES
Bioassay(PubChem)
PATENTS
PATENTS
PubChem Patent
Google Patent